%chk=000010408.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010408

0 1
 O   -7.762100      -1.044700      0.3057000    
 C    2.639800     -0.3016000      2.4300000E-02
 C    1.311900      0.4713000     -0.1439000    
 C   6.5600000E-02 -0.4055000      1.7500000E-02
 C   -2.548300     -0.4506000     -6.8999999E-03
 C   -1.248100      0.3806000     -8.8799998E-02
 C    3.815100      0.6804000     -0.1774000    
 C    5.196100      2.6400000E-02 -5.1399998E-02
 C   -3.755300      0.5103000     -0.1000000    
 C    6.312900       1.067700     -0.1869000    
 C    2.715100      -1.003300       1.383800    
 C    7.727300      0.4607000     -0.1396000    
 C   -2.597700      -1.529700      -1.092100    
 C   -5.110300     -0.1815000      7.6899998E-02
 C   -6.258500      0.8240000     -7.9999998E-04
 C    7.944400     -0.6005000      -1.219200    
 C    7.984700     -0.1477000       1.241200    
 C   -7.620000      0.1640000      0.1282000    
 C   -8.812600       1.079600      2.9400000E-02
 H    2.693800      -1.070100     -0.7576000    
 H    1.290000      0.9407000      -1.135600    
 H    1.270000       1.285800      0.5908000    
 H   0.1063000      -1.187300     -0.7474000    
 H   6.0800001E-02 -0.9028000      0.9918000    
 H   -2.574900     -0.9486000      0.9709000    
 H   -1.260900       1.136100      0.7077000    
 H   -1.242500      0.9350000      -1.036800    
 H    3.730100       1.144400      -1.168400    
 H    3.736800       1.492200      0.5577000    
 H    5.282200     -0.7473000     -0.8206000    
 H    5.292800     -0.4571000      0.9228000    
 H   -3.737600       1.025800      -1.069100    
 H   -3.654700       1.285600      0.6704000    
 H    6.211500       1.822400      0.6031000    
 H    6.193200       1.597800      -1.140500    
 H    1.906000      -1.726900       1.514400    
 H    3.635100      -1.584300       1.491700    
 H    2.666400     -0.2816000       2.205800    
 H    8.446500       1.273500     -0.3001000    
 H   -3.503800      -2.137400      -1.016900    
 H   -1.761900      -2.229200      -1.001100    
 H   -2.565400      -1.086400      -2.092900    
 H   -5.260100     -0.9362000     -0.7023000    
 H   -5.136800     -0.7051000       1.040200    
 H   -6.230200       1.348200     -0.9626000    
 H   -6.163900       1.562600      0.8029000    
 H    7.674900     -0.2125000      -2.207000    
 H    8.999900     -0.8924000      -1.254100    
 H    7.364300      -1.509800      -1.034300    
 H    7.776300      0.5762000       2.035900    
 H    7.382200      -1.043100       1.422900    
 H    9.036200     -0.4423000       1.332100    
 H   -8.817500       1.570800     -0.9467000    
 H   -8.769000       1.825000      0.8272000    
 H   -9.733300      0.4995000      0.1376000    


%chk=000010408-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000010408

0 1
O -7.885720 -0.961863 0.391729
C 2.632855 -0.346186 0.289823
C 1.282779 0.407517 0.139181
C 0.025202 -0.491550 0.096688
C -2.582838 -0.493753 -0.135936
C -1.257071 0.311281 -0.224664
C 3.813955 0.653073 0.145937
C 5.217852 0.009383 0.061922
C -3.794210 0.464512 -0.306040
C 6.320112 1.064400 -0.197907
C 2.704940 -1.131381 1.622038
C 7.780091 0.529699 -0.265860
C -2.620810 -1.651856 -1.162248
C -5.172667 -0.180535 -0.040588
C -6.318140 0.845880 -0.115666
C 7.984369 -0.479111 -1.422570
C 8.250496 -0.070935 1.081486
C -7.710780 0.260187 0.139928
C -8.883537 1.236277 0.074611
H 2.705691 -1.077695 -0.545922
H 1.317032 1.006330 -0.795918
H 1.182430 1.138309 0.970554
H 0.177830 -1.285002 -0.662480
H -0.108097 -1.006233 1.069745
H -2.642617 -0.934955 0.883850
H -1.317337 1.170227 0.477443
H -1.168080 0.749176 -1.242364
H 3.652256 1.261064 -0.769777
H 3.788468 1.365655 0.998580
H 5.219425 -0.745629 -0.750302
H 5.438913 -0.533042 1.001166
H -3.773590 0.888009 -1.333720
H -3.661582 1.323282 0.386385
H 6.263923 1.834941 0.600054
H 6.090357 1.587231 -1.150639
H 1.886977 -1.869271 1.704279
H 3.656758 -1.683843 1.717956
H 2.625879 -0.439252 2.483671
H 8.424929 1.410019 -0.477165
H -3.550625 -2.241863 -1.077068
H -1.776487 -2.349239 -1.018634
H -2.561832 -1.255969 -2.195457
H -5.373008 -0.989984 -0.765938
H -5.179271 -0.659386 0.957798
H -6.332542 1.342858 -1.109677
H -6.154412 1.668964 0.613005
H 7.652720 -0.053928 -2.388841
H 9.051058 -0.755522 -1.520593
H 7.414395 -1.410696 -1.248223
H 8.106584 0.646177 1.911833
H 7.692359 -0.993238 1.329300
H 9.324310 -0.333985 1.041902
H -8.941842 1.704840 -0.926380
H -8.747152 2.056220 0.805233
H -9.827897 0.711490 0.286376


